S424-0399 Screening compound: N~1~-(4-ethoxyphenyl)-2-methyl-2-tetrahydro-2H-pyran-4-ylpropanamide

S424-0399 Screening compound: N~1~-(4-ethoxyphenyl)-2-methyl-2-tetrahydro-2H-pyran-4-ylpropanamide
S424-0399 Screening compound: N~1~-(4-ethoxyphenyl)-2-methyl-2-tetrahydro-2H-pyran-4-ylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S424-0399
N~1~-(4-ethoxyphenyl)-2-methyl-2-tetrahydro-2H-pyran-4-ylpropanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

S424-0399

Molecular Formula

C17H25NO3 (C17 H25 NO3)

Compound Name

N~1~-(4-ethoxyphenyl)-2-methyl-2-tetrahydro-2H-pyran-4-ylpropanamide

IUPAC name

N-(4-ethoxyphenyl)-2-methyl-2-(oxan-4-yl)propanamide

SMILES

CCOc(cc1)ccc1NC(C(C)(C)C1CCOCC1)=O

InChI

InChI=1S/C17H25NO3/c1-4-21-15-7-5-14(6-8-15)18-16(19)17(2,3)13-9-11-20-12-10-13/h5-8,13H,4,9-12H2,1-3H3,(H,18,19)

InChI Key

AJZJSGKIMIXFSX-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

291.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.883

Distribution Coefficient, logD

3.883

Water Solubility, LogSw

-3.75

Polar Surface Area

38.554

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

1.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

S424-0399 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Antibacterial Compounds Library (13827 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S424-0399 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S424-0399?
Check Price and Availability of S424-0399, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S424-0399 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S424-0399
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S424-0399
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of S424-0399 available by request